SCHEMBL25198601

SCHEMBL25198601

O=C(Cn1ccnc1)c1cccc2c1COCO2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 1/20 0.42
▸ PDE4D Q08499 1/20 0.42
▸ CYP19A1 P11511 4/20 0.42
▸ ALPG P10696 2/20 0.41
▸ ALPI P09923 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ PLAA Q9Y263 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA3 P07451 1/20 0.39
▸ CA4 P22748 1/20 0.39
▸ CA6 P23280 1/20 0.39
▸ CA5A P35218 1/20 0.39
▸ CA7 P43166 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ CA13 Q8N1Q1 1/20 0.39
▸ CA14 Q9ULX7 1/20 0.39
▸ CA5B Q9Y2D0 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25192326 0.84 CYP19A1 (0.36) CYP19A1
SCHEMBL28639324 0.80 PDE4B (0.43) PDE4BPDE4DCYP19A1ALPGALPI
SCHEMBL30440486 0.76 CYP19A1 (0.49) CYP19A1
SCHEMBL30440840 0.74 ALDH1A1 (0.37) —
SCHEMBL30440993 0.74 PTPN1 (0.41) —
SCHEMBL11374947 0.73 CYP19A1 (0.46) PDE4BPDE4DCYP19A1ALPGALPI
SCHEMBL11333173 0.73 CYP19A1 (0.46) PDE4BPDE4DCYP19A1ALPGALPI
SCHEMBL29973872 0.71 CYP2C9 (0.40) CA12CA1CA2CA4CA6
Hydrochloric Acid SCHEMBL10972342 0.71 CYP17A1 (0.47) CYP19A1ALPGALPITDP1PLAA
SCHEMBL10476950 0.70 ALPG (0.58) CYP19A1ALPGALPITDP1PLAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850251-B 3, 4-methylenedioxyacetophenone imidazole oxime ether derivative, preparation method and application thereof, and medicine for treating Alzheimer's disease 西北农林科技大学 2024-04-12 — — CN claimed
US-11680062-B2 3,4-methylenedioxyphenylimidazolylethanonexime ether derivative, preparation method and use thereof, and drug for the treatment of Alzheimer's disease NORTHWEST A & F UNIVERSITY (CN) 2023-06-20 — — US claimed
US-20230159503-A1 3,4-METHYLENEDIOXYPHENYLIMIDAZOLYLETHANONEXIME ETHER DERIVATIVE, PREPARATION METHOD AND USE THEREOF, AND DRUG FOR THE TREATMENT OF ALZHEIMER'S DISEASE NORTHWEST A & F UNIVERSITY (CN) 2023-05-25 — — US claimed
CN-115850251-A 3,4-methylenedioxyacetophenone imidazole oxime ether derivative, preparation method and application thereof, and medicine for treating Alzheimer's disease 西北农林科技大学 2023-03-28 — — CN claimed
CN-115850251-B 3, 4-methylenedioxyacetophenone imidazole oxime ether derivative, preparation method and application thereof, and medicine for treating Alzheimer's disease 西北农林科技大学 2024-04-12 — — CN disclosed
US-11680062-B2 3,4-methylenedioxyphenylimidazolylethanonexime ether derivative, preparation method and use thereof, and drug for the treatment of Alzheimer's disease NORTHWEST A & F UNIVERSITY (CN) 2023-06-20 — — US disclosed
US-20230159503-A1 3,4-METHYLENEDIOXYPHENYLIMIDAZOLYLETHANONEXIME ETHER DERIVATIVE, PREPARATION METHOD AND USE THEREOF, AND DRUG FOR THE TREATMENT OF ALZHEIMER'S DISEASE NORTHWEST A & F UNIVERSITY (CN) 2023-05-25 — — US disclosed
CN-115850251-A 3,4-methylenedioxyacetophenone imidazole oxime ether derivative, preparation method and application thereof, and medicine for treating Alzheimer's disease 西北农林科技大学 2023-03-28 — — CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230159503-A1 3,4-METHYLENEDIOXYPHENYLIMIDAZOLYLETHANONEXIME ETHER DERIVATIVE, PREPARATION METHOD AND USE THEREOF, AND DRUG FOR THE TREATMENT OF ALZHEIMER'S DISEASE NOS3, CYP51A1, NOS1 PDE4B 944/4885PDE4D 1242/4885CYP19A1 71/4885
US-11680062-B2 3,4-methylenedioxyphenylimidazolylethanonexime ether derivative, preparation method and use thereof, and drug for the treatment of Alzheimer's disease NOS3, CYP51A1, NOS1 PDE4B 944/4885PDE4D 1242/4885CYP19A1 71/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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